SCHEMBL3197665

SCHEMBL3197665

CN(O)c1cc(N)ccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.52
▸ PRKCI P41743 1/20 0.47
▸ CASP1 P29466 3/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ ACHE P22303 1/20 0.46
▸ ALDH1A1 P00352 6/20 0.42
▸ ALOX15 P16050 5/20 0.42
▸ HSD17B10 Q99714 4/20 0.42
▸ TDP1 Q9NUW8 4/20 0.42
▸ CYP3A4 P08684 3/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ THRB P10828 2/20 0.42
▸ CYP2C9 P11712 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ BRCA1 P38398 2/20 0.42
▸ RECQL P46063 2/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8536213 0.86 APP (0.53) PDE10APRKCICASP1CA1CA2
SCHEMBL18509676 0.80 ALDH1A1 (0.50) PDE10APRKCICASP1TSHRACHE
SCHEMBL7756464 0.77 PRKCI (0.56) PDE10APRKCICASP1CA1CA2
SCHEMBL7884400 0.75 PDE10A (0.45) PDE10APRKCICASP1CA1CA2
SCHEMBL15490156 0.73 TSHR (0.52) PDE10APRKCICASP1CA1CA2
Trimethylammonium SCHEMBL27731909 0.73 PDE10A (0.86) PDE10APRKCICASP1CA1CA2
Hydrochloric Acid SCHEMBL15486297 0.71 TSHR (0.50) PDE10APRKCICASP1CA1CA2
SCHEMBL6752755 0.71 PRKCI (0.42) PDE10APRKCICASP1CA1CA2
Ethane SCHEMBL11239269 0.70 CASP1 (0.61) PDE10APRKCICASP1CA1CA2
SCHEMBL3338265 0.70 PRKCI (0.69) PDE10APRKCICASP1CA1CA2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1453476-B1 NOVEL OXIDATION DYES COMPRISING 2,4-DICHLORO-3-AMINOPHENOL HENKEL KGAA (DE) 2006-05-03 — — EP claimed
EP-1309540-B1 OXIDIZING COLORANT HENKEL KGAA (DE) 2005-11-02 — — EP claimed
EP-1309540-A1 OXIDIZING COLORANT Henkel Kommanditgesellschaft auf Aktien (DE) 2003-05-14 — — EP claimed
WO-2002010118-A1 OXIDIZING COLORANT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2002-02-07 — — WO claimed
EP-2037871-B1 OXIDATION DYES FOR DYEING KERATIN FIBERS CONTAINING ATMOSPHERIC OXYGEN AS THE ONLY OXIDIZING AGENT HENKEL AG & CO KGAA (DE) 2016-02-24 — — EP disclosed
EP-2934462-A2 TWO-PHASE DEVELOPER FOR OXIDATIVE COLOR CHANGING AGENTS Henkel AG&Co. KGAA (DE) 2015-10-28 — — EP disclosed
WO-2014095458-A2 TWO-PHASE DEVELOPER FOR OXIDATIVE COLOR CHANGING AGENTS HENKEL AG & CO. KGAA (DE) 2014-06-26 — — WO disclosed
EP-1536757-B1 HAIR TREATMENT AGENT HENKEL AG & CO KGAA (DE) 2013-10-23 — — EP disclosed
US-20100047202-A1 Hair-Conditioning Agents Containing Selected Cationic Polymers and Water-Soluble Silicones HENKEL AG & CO.KGAA (DE) 2010-02-25 — — US disclosed
EP-2037871-A1 OXIDATION DYES FOR DYEING KERATIN FIBERS CONTAINING ATMOSPHERIC OXYGEN AS THE ONLY OXIDIZING AGENT Henkel AG & Co. KGaA (DE) 2009-03-25 — — EP disclosed
WO-2008003686-A1 OXIDATION DYES FOR DYEING KERATIN FIBERS CONTAINING ATMOSPHERIC OXYGEN AS THE ONLY OXIDIZING AGENT HENKEL AG & CO. KGAA (DE) 2008-01-10 — — WO disclosed
EP-1406577-B1 NOVEL COUPLER COMPONENTS FOR OXIDATIVE HAIR COLOURING HENKEL KGAA (DE) 2007-10-10 — — EP disclosed
WO-2002039966-A2 ENZYMATIC COLORING AGENTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2002-05-23 — — WO disclosed
WO-2002010118-A1 OXIDIZING COLORANT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2002-02-07 — — WO disclosed
WO-2002005767-A1 OXIDISED HAIR COLOURING AGENTS CONTAINING AT LEAST ONE DISUBSTITUITED 2.4-DIAMINO PHENYL ETHER AS A COUPLING COMPONENT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2002-01-24 — — WO disclosed
WO-2002006207-A2 NOVEL COUPLING COMPONENTS FOR OXIDATION COLOURING AGENTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2002-01-24 — — WO disclosed
WO-2001097766-A2 OXIDISED HAIR DYE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-12-27 — — WO disclosed
WO-2001097756-A2 NOVEL COUPLING COMPONENT FOR OXIDATIVE HAIR DYES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-12-27 — — WO disclosed
WO-2001098276-A1 PARA-AMINOPHENOL DERIVATIVES AND THEIR USE AS DEVELOPERS FOR PRODUCING OXIDATION COLORATIONS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-12-27 — — WO disclosed
WO-2001093818-A1 OXIDATION DYEING METHOD FOR KERATINOUS FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-12-13 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100047202-A1 Hair-Conditioning Agents Containing Selected Cationic Polymers and Water-Soluble Silicones KRT18, CUTA, HDAC10 PDE10A 2257/4885PRKCI 545/4885CASP1 3377/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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